η1-(2-PhC6H4CH2C(O))Co(CO)3PPh3 | 634599-80-7

• 英文名称: η1-(2-PhC6H4CH2C(O))Co(CO)3PPh3
• CAS: 634599-80-7
• 化学式: C₃₅H₂₆CoO₄P
• 分子量: 600.556
• InChiKey: MQKAFLMFSWKMFH-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  None
• 重原子数：
  None
• 可旋转键数：
  None
• 环数：
  None
• sp3杂化的碳原子比例：
  None
• 拓扑面积：
  None
• 氢给体数：
  None
• 氢受体数：
  None

反应信息

• 作为反应物：
  描述：

  η1-(2-PhC6H4CH2C(O))Co(CO)3PPh3 以 乙醚 为溶剂， 生成 η1-(2-PhC6H4CH2)Co(CO)3PPh3
  参考文献：
  名称：

  Intermediates of cobalt-catalysed PTC carbonylation of benzyl halides

  摘要：

  Intermediates of the cobalt carbonyl-catalysed carbonylation of ortho-substituted benzyl halides were identified by IR, H-1- and C-13-NMR spectra. The molecular structures of the acyl-type derivatives 2-MeC6H4CH2(O)Co(CO)(3)PPh3 and 2-PhC6R4CH2C(O)Co(CO)(3)PPh3 were determined by X-ray crystallography. Structural features of these complexes are discussed. (C) 2003 Elsevier Science B.V. All rights reserved.

  DOI：

  10.1016/s1381-1169(03)00303-0
• 作为产物：
  描述：

  sodium tetracarbonyl cobaltate 、 2-苯基溴化甲基苯 、 三苯基膦 在 CO 作用下， 以 乙醚 为溶剂， 以41.2%的产率得到η1-(2-PhC6H4CH2C(O))Co(CO)3PPh3
  参考文献：
  名称：

  Intermediates of cobalt-catalysed PTC carbonylation of benzyl halides

  摘要：

  Intermediates of the cobalt carbonyl-catalysed carbonylation of ortho-substituted benzyl halides were identified by IR, H-1- and C-13-NMR spectra. The molecular structures of the acyl-type derivatives 2-MeC6H4CH2(O)Co(CO)(3)PPh3 and 2-PhC6R4CH2C(O)Co(CO)(3)PPh3 were determined by X-ray crystallography. Structural features of these complexes are discussed. (C) 2003 Elsevier Science B.V. All rights reserved.

  DOI：

  10.1016/s1381-1169(03)00303-0